2-[2,3-bis[2-(triethylazaniumyl)ethoxy]phenoxy]ethyl-triethyl-azanium iodide

Systemtic Name: 2-[2,3-bis[2-(triethylazaniumyl)ethoxy]phenoxy]ethyl-triethyl-azanium iodide Openeye Name: 2-[2,3-bis[2-(triethylammonio)ethoxy]phenoxy]ethyl-triethyl-ammonium iodide CAS Name: 2-[2,3-bis[2-(triethylammonio)ethoxy]phenoxy]ethyl-triethylammonium iodide IUPAC Name: 2-[2,3-bis[2-(triethylazaniumyl)ethoxy]phenoxy]ethyl-triethylazanium iodide Traditional Name: 2-[2,3-bis[2-(triethylammonio)ethoxy]phenoxy]ethyl-triethyl-ammonium iodide Formula: C30H60IN3O3+2 MolecularWeight: 637.72017

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(CC)CCOC1=C(C(=CC=C1)OCC[N+](CC)(CC)CC)OCC[N+](CC)(CC)CC.[I-]

Isomeric SMILES

CC[N+](CC)(CC)CCOC1=C(C(=CC=C1)OCC[N+](CC)(CC)CC)OCC[N+](CC)(CC)CC.[I-]

InChI

InChI=1S/C30H60N3O3.HI/c1-10-31(11-2,12-3)22-25-34-28-20-19-21-29(35-26-23-32(13-4,14-5)15-6)30(28)36-27-24-33(16-7,17-8)18-9;/h19-21H,10-18,22-27H2,1-9H3;1H/q+3;/p-1